ethyl 4-(4-chlorophenyl)-5-methyl-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-5-methyl-2-[(3-nitrophenyl)sulfonylamino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-5-methyl-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylic acid ethyl ester Formula: C20H17ClN2O6S2 MolecularWeight: 480.94178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClN2O6S2/c1-3-29-20(24)18-17(13-7-9-14(21)10-8-13)12(2)30-19(18)22-31(27,28)16-6-4-5-15(11-16)23(25)26/h4-11,22H,3H2,1-2H3